bis(trifluoromethylsulfonyl)azanide; methyl 3-methyl-2-(3-methylimidazol-3-ium-1-yl)pentanoate

Systemtic Name: bis(trifluoromethylsulfonyl)azanide; methyl 3-methyl-2-(3-methylimidazol-3-ium-1-yl)pentanoate Openeye Name: bis(trifluoromethylsulfonyl)azanide; methyl 3-methyl-2-(3-methylimidazol-3-ium-1-yl)pentanoate CAS Name: bis(trifluoromethylsulfonyl)azanide; 3-methyl-2-(3-methyl-1-imidazol-3-iumyl)pentanoic acid methyl ester IUPAC Name: bis(trifluoromethylsulfonyl)azanide; methyl 3-methyl-2-(3-methylimidazol-3-ium-1-yl)pentanoate Traditional Name: ditriflylazanide; 3-methyl-2-(3-methylimidazol-3-ium-1-yl)valeric acid methyl ester Formula: C13H19F6N3O6S2 MolecularWeight: 491.426879

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)N1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

Isomeric SMILES

CCC(C)C(C(=O)OC)N1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C11H19N2O2.C2F6NO4S2/c1-5-9(2)10(11(14)15-4)13-7-6-12(3)8-13;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h6-10H,5H2,1-4H3;/q+1;-1